8-bromanyl-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-2-ium bromide

Systemtic Name: 8-bromanyl-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-2-ium bromide Openeye Name: 2-benzyl-8-bromo-9H-pyrido[3,4-b]indol-2-ium bromide CAS Name: 8-bromo-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-2-ium bromide IUPAC Name: 2-benzyl-8-bromo-9H-pyrido[3,4-b]indol-2-ium bromide Traditional Name: 2-benzyl-8-bromo-9H-$b-carbolin-2-ium bromide Formula: C18H14Br2N2 MolecularWeight: 418.12516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC3=C(C=C2)C4=C(N3)C(=CC=C4)Br.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC3=C(C=C2)C4=C(N3)C(=CC=C4)Br.[Br-]

InChI

InChI=1S/C18H13BrN2.BrH/c19-16-8-4-7-15-14-9-10-21(12-17(14)20-18(15)16)11-13-5-2-1-3-6-13;/h1-10,12H,11H2;1H